(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2,4-ditert-butylphenoxy)ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2,4-ditert-butylphenoxy)ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(2,4-ditert-butylphenoxy)acetate CAS Name: 2-(2,4-ditert-butylphenoxy)acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(2,4-ditert-butylphenoxy)acetate Traditional Name: 2-(2,4-ditert-butylphenoxy)acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)COC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)COC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C22H30N2O4/c1-14(24)16(11-23)18(25)12-28-20(26)13-27-19-9-8-15(21(2,3)4)10-17(19)22(5,6)7/h8-10,16,24H,12-13H2,1-7H3